Exact Mass: 671.307

tryptophyllin L 1.3

C36H45N7O6 (671.3431)

Polymastiamide B

gobichelin A

C30H41N9O9 (671.3027)

Glu Lys His Cys Arg

C26H45N11O8S (671.3173)

Thr Tyr Phe Asn Lys

Tyr Thr Phe Lys Asn

Cycloaspeptide H_130057

C37H45N5O7 (671.3319)

Ferrioxamine G1 [M+Fe-2H]

C27H47FeN6O10 (671.2703)

16-demethoxy-20-epi-serpentinine

[C41H43N4O5]+ (671.3233)

YTFKN

Tyr-Thr-Phe-Lys-Asn

TYFNK

Thr Tyr Phe Asn Lys

EKHCR

Glu Lys His Cys Arg

C26H45N11O8S (671.3173)

(9H-FLUOREN-9-YL)METHYL (6-(BIS(4-METHOXYPHENYL)(PHENYL)METHOXY)-5-(HYDROXYMETHYL)HEXYL)CARBAMATE

C43H45NO6 (671.3247)

(7E,9R,10S,11R,12R,13R,14R,15R,16S,17S,18E,20Z)-2,4,10,12,14,16-hexahydroxy-9,21-bis(hydroxymethyl)-3,7,11,13,15,17-hexamethyl-23-azatricyclo[22.3.1.05,27]octacosa-1,3,5(27),7,18,20,24-heptaene-6,22,26,28-tetrone

(7E,9R,10S,11R,12R,13R,14R,15R,16S,17S,18E,20Z)-2,4,10,12,14,16-hexahydroxy-9,21-bis(hydroxymethyl)-3,7,11,13,15,17-hexamethyl-23-azatricyclo[22.3.1.05,27]octacosa-1,3,5(27),7,18,20,24-heptaene-6,22,26,28-tetrone

Rif5 intermediate 1

N-[[(3R,9R,10S)-16-(benzenesulfonamido)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3S,9R,10S)-16-(benzenesulfonamido)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3S,9S,10R)-16-(benzenesulfonamido)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3R,9S,10S)-16-(benzenesulfonamido)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3R,9R,10R)-16-(benzenesulfonamido)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-16-(thiophen-2-ylsulfonylamino)-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methyl-2-phenylacetamide

C34H45N3O7S2 (671.2699)

N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(thiophen-2-ylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

C34H45N3O7S2 (671.2699)

N-[[(3S,9R,10S)-16-(benzenesulfonamido)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3R,9R,10S)-16-(benzenesulfonamido)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3R,9S,10S)-16-(benzenesulfonamido)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3S,9S,10S)-16-(benzenesulfonamido)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3S,9R,10R)-16-(benzenesulfonamido)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3R,9R,10R)-16-(benzenesulfonamido)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3S,9S,10R)-16-(benzenesulfonamido)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3R,9S,10R)-16-(benzenesulfonamido)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3S,9S,10S)-16-(benzenesulfonamido)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

N-[[(3R,9S,10R)-16-(benzenesulfonamido)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-4,4,4-trifluoro-N-methylbutanamide

16-demethoxy-20-epi-serpentinine

C41H43N4O5+ (671.3233)

PC 18:3/7:3;O3

PC 18:4/7:2;O3

PC 25:6;O3

PE 20:3/8:3;O3

PE 20:4/8:2;O3

PE 28:6;O3

LNAPS 27:5;O

PS O-27:6;O2

PS P-18:1/9:4;O2

PS 18:3/8:3;O2

PS 18:4/7:3;O3

C31H46NO13P (671.2707)

PS 18:4/8:2;O2

PS 18:4/9:1;O

PS 20:2/7:3;O

PS 22:4/5:1;O

PS 22:5/4:1;O2

PS 25:7;O3

C31H46NO13P (671.2707)

PS 26:6;O2

PS 27:5;O

ST 25:2;O8;HexNAc

C33H53NO13 (671.3517)

ST 28:7;O6;HexNAc

C36H49NO11 (671.3305)

1α-nicotinoyloxy-2α-acetoxy-6β-acetoxy-9β-furoyloxy-11-isobutyryloxy-4β-hydroxydi-hydro-β-agarofuran

C34H41NO13 (671.2578)

{"Ingredient_id": "HBIN002315","Ingredient_name": "1\u03b1-nicotinoyloxy-2\u03b1-acetoxy-6\u03b2-acetoxy-9\u03b2-furoyloxy-11-isobutyryloxy-4\u03b2-hydroxydi-hydro-\u03b2-agarofuran","Alias": "NA","Ingredient_formula": "C34H41NO13","Ingredient_Smile": "CC(C)C(=O)OCC12C(CC3C(C1(C(CC(C2OC(=O)C4=CN=CC=C4)OC(=O)C)(C)O)OC3(C)C)OC(=O)C)OC(=O)C5=COC=C5","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "15527","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

(2s,5s,8s,11s,14s,15r)-4,17-dihydroxy-8-[(4-hydroxyphenyl)methyl]-5,11-diisopropyl-2,6,9,14-tetramethyl-15-propyl-12-oxa-20-thia-3,6,9,16,21-pentaazabicyclo[16.2.1]henicosa-1(21),3,16,18-tetraene-7,10,13-trione

(2s,5s,8s,11s,14s,15r)-4,17-dihydroxy-8-[(4-hydroxyphenyl)methyl]-5,11-diisopropyl-2,6,9,14-tetramethyl-15-propyl-12-oxa-20-thia-3,6,9,16,21-pentaazabicyclo[16.2.1]henicosa-1(21),3,16,18-tetraene-7,10,13-trione

C34H49N5O7S (671.3353)

(s)-{[(2e,6r)-6-[(1r,5as,6s,7s,9as,9br,11ar)-6,9a,11a-trimethyl-7-(sulfooxy)-1h,2h,3h,4h,5h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-hydroxy-2-methylhept-2-en-1-ylidene]amino}(4-methoxyphenyl)acetic acid

(s)-{[(2e,6r)-6-[(1r,5as,6s,7s,9as,9br,11ar)-6,9a,11a-trimethyl-7-(sulfooxy)-1h,2h,3h,4h,5h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-hydroxy-2-methylhept-2-en-1-ylidene]amino}(4-methoxyphenyl)acetic acid

(7z,9s,10s,11s,12r,13s,14s,15r,16s,17s,18e,20z)-2,4,10,12,14,16,22-heptahydroxy-9,21-bis(hydroxymethyl)-3,7,11,13,15,17-hexamethyl-23-azatricyclo[22.3.1.0⁵,²⁷]octacosa-1(27),2,4,7,18,20,22,24-octaene-6,26,28-trione

(7z,9s,10s,11s,12r,13s,14s,15r,16s,17s,18e,20z)-2,4,10,12,14,16,22-heptahydroxy-9,21-bis(hydroxymethyl)-3,7,11,13,15,17-hexamethyl-23-azatricyclo[22.3.1.0⁵,²⁷]octacosa-1(27),2,4,7,18,20,22,24-octaene-6,26,28-trione

5-hydroxy-n-(1-{2-[(1-{[1-(c-hydroxycarbonimidoyl)-3-methylbutyl]-c-hydroxycarbonimidoyl}-2-(1h-indol-3-yl)ethyl)-c-hydroxycarbonimidoyl]pyrrolidin-1-yl}-1-oxo-3-phenylpropan-2-yl)-3,4-dihydro-2h-pyrrole-2-carboximidic acid

5-hydroxy-n-(1-{2-[(1-{[1-(c-hydroxycarbonimidoyl)-3-methylbutyl]-c-hydroxycarbonimidoyl}-2-(1h-indol-3-yl)ethyl)-c-hydroxycarbonimidoyl]pyrrolidin-1-yl}-1-oxo-3-phenylpropan-2-yl)-3,4-dihydro-2h-pyrrole-2-carboximidic acid

C36H45N7O6 (671.3431)

8-acetyl-6,8,11-trihydroxy-10-{[5-hydroxy-2-(2-hydroxypropyl)-4,10-dimethyl-octahydro-2h-pyrano[3,4-d][1,3,6]dioxazocin-8-yl]oxy}-1-methoxy-9,10-dihydro-7h-tetracene-5,12-dione

C34H41NO13 (671.2578)

(2s)-5-hydroxy-n-[(2s)-1-[(2r)-2-{[(1s)-1-{[(1s)-1-(c-hydroxycarbonimidoyl)-3-methylbutyl]-c-hydroxycarbonimidoyl}-2-(1h-indol-3-yl)ethyl]-c-hydroxycarbonimidoyl}pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]-3,4-dihydro-2h-pyrrole-2-carboximidic acid

(2s)-5-hydroxy-n-[(2s)-1-[(2r)-2-{[(1s)-1-{[(1s)-1-(c-hydroxycarbonimidoyl)-3-methylbutyl]-c-hydroxycarbonimidoyl}-2-(1h-indol-3-yl)ethyl]-c-hydroxycarbonimidoyl}pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]-3,4-dihydro-2h-pyrrole-2-carboximidic acid

C36H45N7O6 (671.3431)

(s)-{[(6r)-6-[(1r,5as,7s,9as,9br,11ar)-9a,11a-dimethyl-7-(sulfooxy)-1h,2h,3h,4h,5h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-hydroxy-3-methyl-2-methylideneheptylidene]amino}(4-methoxyphenyl)acetic acid

(s)-{[(6r)-6-[(1r,5as,7s,9as,9br,11ar)-9a,11a-dimethyl-7-(sulfooxy)-1h,2h,3h,4h,5h,5ah,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-hydroxy-3-methyl-2-methylideneheptylidene]amino}(4-methoxyphenyl)acetic acid

4,17-dihydroxy-8-[(4-hydroxyphenyl)methyl]-5,11-diisopropyl-2,6,9,14-tetramethyl-15-propyl-12-oxa-20-thia-3,6,9,16,21-pentaazabicyclo[16.2.1]henicosa-1(21),3,16,18-tetraene-7,10,13-trione

C34H49N5O7S (671.3353)

2,4,10,12,14,16,22-heptahydroxy-9,21-bis(hydroxymethyl)-3,7,11,13,15,17-hexamethyl-23-azatricyclo[22.3.1.0⁵,²⁷]octacosa-1,3,5(27),7,18,20,22,24-octaene-6,26,28-trione