(Q105014806)

English

(1S,4R,4aS,5R,7R,7aS,8R,11aR)-8-(1H-indol-3-yl)-4,4a,7-trimethyl-9-propan-2-yl-1,2,3,4,5,6,7,7a,8,11-decahydrobenzo[d]naphthalene-1,5-diol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

8-(1H-indol-3-yl)-9-isopropyl-4,4a,7-trimethyl-1H,2H,3H,4H,5H,6H,7H,7aH,8H,11H-cyclohexa[e]naphthalene-1,5-diol

1 reference

based on heuristic

inferred from SMILES

mass

421.298079488 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₈H₃₉NO₂

0 references

canonical SMILES

OC1CCC(C)C2(C)C(O)CC(C)C3C(C4=CNC=5C=CC=CC54)C(=CCC132)C(C)C

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isomeric SMILES

CC(C)C1=CC[C@]23[C@@H](O)CC[C@@H](C)[C@]2(C)[C@H](O)C[C@@H](C)[C@H]3[C@H]1c1c[nH]c2ccccc12

0 references

found in taxon

Aspergillus flavus

1 reference

stated in

Antiinsectan aflavinine derivatives from the sclerotia of Aspergillus flavus

Identifiers

InChI

InChI=1S/C28H39NO2/c1-16(2)19-12-13-28-23(30)11-10-18(4)27(28,5)24(31)14-17(3)26(28)25(19)21-15-29-22-9-7-6-8-20(21)22/h6-9,12,15-18,23-26,29-31H,10-11,13-14H2,1-5H3/t17-,18-,23+,24-,25-,26+,27-,28-/m1/s1

0 references

InChIKey

GPFSZBMHJJSJDS-NQVQPJRKSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

GPFSZBMHJJSJDS-NQVQPJRKSA-N

(Q105014806)

(1S,4R,4aS,5R,7R,7aS,8R,11aR)-8-(1H-indol-3-yl)-4,4a,7-trimethyl-9-propan-2-yl-1,2,3,4,5,6,7,7a,8,11-decahydrobenzo[d]naphthalene-1,5-diol

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Identifiers

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