decipienolide A and B

ID: ALA2068677

Chembl Id: CHEMBL2068677

PubChem CID: 70684523

Max Phase: Preclinical

Molecular Formula: C42H60O12

Molecular Weight: 756.93

Molecule Type: Small molecule

Names and Identifiers

Canonical SMILES:  C=C1C(OC(=O)C(C)(C)C(C)O)CC2CC1C21CO[C@@]2(C[C@H](C)C(=O)O2)C1.C=C1C(OC(=O)C(C)(C)C(C)O)CC2CC1C21CO[C@]2(C[C@H](C)C(=O)O2)C1

Standard InChI:  InChI=1S/2C21H30O6/c2*1-11-8-21(27-17(11)23)9-20(10-25-21)14-6-15(20)12(2)16(7-14)26-18(24)19(4,5)13(3)22/h2*11,13-16,22H,2,6-10H2,1,3-5H3/t11-,13?,14?,15?,16?,20?,21+;11-,13?,14?,15?,16?,20?,21-/m00/s1

Standard InChI Key:  UVCTULIZVFLWNG-CELMCRRESA-N

Alternative Forms

1. Parent:

   

   ALA2068677

   DECIPIENOLIDE A AND B

Molecule Features

Natural Product: No

Oral: No

Chemical Probe: No

Parenteral: No

Molecule Type: Small molecule

Topical: No

First In Class: No

Black Box: No

Chirality: No

Availability: No

Prodrug: No

Calculated Properties

Molecular Weight: 756.93

Molecular Weight (Monoisotopic): 756.4085

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References

1. Che Y, Gloer JB, Koster B, Malloch D..  (2002)  Decipinin A and decipienolides A and B: new bioactive metabolites from the coprophilous fungus Podospora decipiens.,  65  (6): [PMID:12088438] [10.1021/np010575p]

Source

Source(1):

• Scientific Literature