tirucalla-7,24-diene-3β-ol

Chemical Formula:

C₃₀H₅₀O

Molecular Weight:

426.724 Daltons

Monoisotopic Mass:

426.3861662271 Daltons

SMILES:

CC(C)=CCCC(C)C1(CCC2(C1(C)CCC3(C2=CC[CH]4(C(C)3CCC(O)C(C)(C)4)))(C))

InChI:

1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,12,21-23,25-26,31H,9,11,13-19H2,1-8H3/t21-,22?,23?,25-,26-,28+,29-,30+/m0/s1

InChIKey:

DICCPNLDOZNSML-ZVSNHUJDSA-N

Databases

MetaCyc: CPD-13276

MetaboLights: MTBLC63468

ChEBI: 63468

PubChem (CID): 472760

Seed: cpd23808

MetaNetX: MNXM169250