(1R,14S)-6,9,20,25-tetramethoxy-15,30-dimethyl-23-oxa-15,30-diazaheptacyclo[22.6.2.1³,⁷.1⁸,¹².1¹⁴,¹⁸.0²⁷,³¹.0²²,³³]pentatriaconta-3(35),4,6,8,10,12(34),18,20,22(33),24,26,31-dodecaen-21-ol
AlkaPlorer ID: AK096990
Synonym: None
IUPAC Name: (1R,14S)-6,9,20,25-tetramethoxy-15,30-dimethyl-23-oxa-15,30-diazaheptacyclo[22.6.2.13,7.18,12.114,18.027,31.022,33]pentatriaconta-3(35),4,6,8,10,12(34),18,20,22(33),24,26,31-dodecaen-21-ol
Structure
SMILES: COC1=C2C=C3C(=C1)CCN(C)[C@@H]3CC1=CC=C(OC)C(=C1)C1=CC(=CC=C1OC)C[C@H]1C3=C(C=C(OC)C(O)=C3O2)CCN1C
InChI: InChI=1S/C38H42N2O6/c1-39-13-11-24-19-33(44-5)34-21-26(24)29(39)17-22-7-9-31(42-3)27(15-22)28-16-23(8-10-32(28)43-4)18-30-36-25(12-14-40(30)2)20-35(45-6)37(41)38(36)46-34/h7-10,15-16,19-21,29-30,41H,11-14,17-18H2,1-6H3/t29-,30+/m1/s1
InChIKey: MMPRUQLJCQZAHE-IHLOFXLRSA-N
Reference
Bisbenzylisoquinoline alkaloids from Guatteria boliviana (Annonaceae)
PubChem CID: 102153330
LOTUS: LTS0273497
SuperNatural Ⅲ: SN0229694-01
NPASS: NPC189399
Source
Properties Information
Molecule Weight: 622.7620000000002
TPSA？: 72.86
MolLogP？: 6.742700000000008
Number of H-Donors: 1
Number of H-Acceptors: 8
RingCount: 7
Activities Information
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