(Q105147698)

English

(3S,9S,10R,13R,14R,17R)-17-[(E,2R,5R)-5,7-dimethyloct-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

17-(5,7-dimethyloct-3-en-2-yl)-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

1 reference

based on heuristic

inferred from SMILES

mass

410.354866092 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₄₆O

0 references

canonical SMILES

OC1CC2=CC=C3C(CCC4(C)C3CCC4C(C=CC(C)CC(C)C)C)C2(C)CC1

0 references

isomeric SMILES

CC(C)C[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2C3=CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C

0 references

found in taxon

Agelas sceptrum

1 reference

stated in

26-Nor-25-isopropyl-ergosta-5,7,22E-trien-3beta-ol: a new C(29) sterol from the sponge Agelas sceptrum from Jamaica

Identifiers

InChI

InChI=1S/C29H46O/c1-19(2)17-20(3)7-8-21(4)25-11-12-26-24-10-9-22-18-23(30)13-15-28(22,5)27(24)14-16-29(25,26)6/h7-10,19-21,23,25-27,30H,11-18H2,1-6H3/b8-7+/t20-,21+,23-,25+,26-,27-,28-,29+/m0/s1

0 references

InChIKey

KYFQWFLHOZFGNN-GZMOTIRBSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KYFQWFLHOZFGNN-GZMOTIRBSA-N

(Q105147698)

(3S,9S,10R,13R,14R,17R)-17-[(E,2R,5R)-5,7-dimethyloct-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol

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Identifiers

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