(Q105359566)

English

(3aS,5aR,7S,9aR,9bS)-3-(6,10-dimethylundeca-3,5,9-trien-2-ylidene)-7-hydroxy-3a,6,6,9a-tetramethyl-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-2-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

3-(6,10-Dimethylundeca-3,5,9-trien-2-ylidene)-7-hydroxy-3a,6,6,9a-tetramethyl-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-2-one

1 reference

based on heuristic

inferred from SMILES

mass

438.349780712 dalton

1 reference

1 reference

C₃₀H₄₆O₂

0 references

canonical SMILES

O=C1C(=C(C=CC=C(C)CCC=C(C)C)C)C2(C)CCC3C(C)(C)C(O)CCC3(C)C2C1

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isomeric SMILES

CC(C)=CCCC(C)=CC=CC(C)=C1C(=O)C[C@@H]2[C@]1(C)CC[C@H]1C(C)(C)[C@@H](O)CC[C@]21C

0 references

found in taxon

Rhabdastrella globostellata

1 reference

stated in

New isomalabaricane triterpenes from the marine sponge Stelletta globostellata that induce morphological changes in rat fibroblasts.

Identifiers

InChI

InChI=1S/C30H46O2/c1-20(2)11-9-12-21(3)13-10-14-22(4)27-23(31)19-25-29(7)18-16-26(32)28(5,6)24(29)15-17-30(25,27)8/h10-11,13-14,24-26,32H,9,12,15-19H2,1-8H3/t24-,25-,26-,29-,30-/m0/s1

0 references

InChIKey

YSFGMSKQXKVXAR-IJUWOWPVSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YSFGMSKQXKVXAR-IJUWOWPVSA-N

(Q105359566)

(3aS,5aR,7S,9aR,9bS)-3-(6,10-dimethylundeca-3,5,9-trien-2-ylidene)-7-hydroxy-3a,6,6,9a-tetramethyl-1,4,5,5a,7,8,9,9b-octahydrocyclopenta[a]naphthalen-2-one

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Identifiers

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