(Q104399199)

English

(1S,3aR,4R,8aS)-7-isopropyl-1,4-dimethyl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

(1S,4R)-7-isopropyl-1,4-dimethyl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol

1 reference

based on heuristic

inferred from SMILES

1,4-Dimethyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol

1 reference

based on heuristic

inferred from SMILES

mass

238.193280072 dalton

1 reference

2 references

inferred from InChIKey

based on heuristic

inferred from InChI

(1S,3aS,4R,8aS)-1,4-dimethyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol

1 reference

based on heuristic

inferred from InChI

(1R,3aR,4R,8aR)-1,4-dimethyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol

1 reference

based on heuristic

inferred from InChI

(1R,3aS,4R,8aR)-1,4-dimethyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol

1 reference

based on heuristic

inferred from InChI

(1R,3aS,4R,8aS)-1,4-dimethyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol

1 reference

based on heuristic

inferred from InChI

(1S,3aR,4R,8aR)-1,4-dimethyl-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol

1 reference

1 reference

C₁₅H₂₆O₂

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canonical SMILES

OC1(C)CCC2C1C=C(CCC2(O)C)C(C)C

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isomeric SMILES

CC(C)C1=C[C@H]2[C@@H](CC[C@]2(C)O)[C@](C)(O)CC1

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found in taxon

Guarea kunthiana

1 reference

stated in

Terpenoid constituents from leaves of Guarea kunthiana

Curcuma zedoaria

2 references

stated in

Hepatoprotective constituents from zedoariae rhizoma: absolute stereostructures of three new carabrane-type sesquiterpenes, curcumenolactones A, B, and C.

stated in

Medicinal foodstuffs. XXVIII. Inhibitors of nitric oxide production and new sesquiterpenes, zedoarofuran, 4-epicurcumenol, neocurcumenol, gajutsulactones A and B, and zedoarolides A and B, from Zedoariae Rhizoma

Curcuma phaeocaulis

1 reference

stated in

Guaiane-type sesquiterpenes from Curcuma phaeocaulis and their inhibitory effects on nitric oxide production.

Viburnum cylindricum

1 reference

stated in

Seven New Phenolic Glucosides fromViburnum cylindricum

Alisma plantago-aquatica

1 reference

stated in

Inhibitory Effects and Active Constituents ofAlismaRhizomes on Vascular Contraction Induced by High Concentration of KCl

Ziziphus spina-christi

1 reference

stated in

Chemical Constituents from the Seeds of Ziziphus jujuba var. spinosa (Bunge) Hu

Identifiers

InChI

InChI=1S/C15H26O2/c1-10(2)11-5-7-14(3,16)12-6-8-15(4,17)13(12)9-11/h9-10,12-13,16-17H,5-8H2,1-4H3/t12-,13+,14-,15+/m1/s1

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InChIKey

IWQURBSTAIRNAE-BARDWOONSA-N

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2 references

26 December 2021

matched by identifier from

InChIKey

IWQURBSTAIRNAE-BARDWOONSA-N

1 reference

0 references

(Q104399199)

(1S,3aR,4R,8aS)-7-isopropyl-1,4-dimethyl-2,3,3a,5,6,8a-hexahydroazulene-1,4-diol

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Identifiers

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