Try beta.chemspider
- 7 of 7 defined stereocentres
(3S,6S,9S,12S,15R,20aS)-15-Benzyl-6-[(2S)-2-butanyl]-3,5,11,12-tetramethyl-9-{4-[(3-methyl-2-buten-1-yl)oxy]benzyl}dodecahydro-1H-pyrrolo[1,2-d][1,4,7,10,13,16]oxapentaazacyclooctadecine-1,4,7,10,13,1 6(15H)-hexone
CC(C)=CCOC1=CC=C(C[C@@H]2NC(=O)[C@H]([C@@H](C)CC)N(C)C(=O)[C@H](C)NC(=O)[C@@H]3CCCN3C(=O)[C@@H](CC3C=CC=CC=3)OC(=O)[C@H](C)N(C)C2=O)C=C1
InChI=1S/C42H57N5O8/c1-9-27(4)36-38(49)44-33(24-31-17-19-32(20-18-31)54-23-21-26(2)3)40(51)45(7)29(6)42(53)55-35(25-30-14-11-10-12-15-30)41(52)47-22-13-16-34(47)37(48)43-28(5)39(50)46(36)8/h10-12,14-15,17-21,27-29,33-36H,9,13,16,22-25H2,1-8H3,(H,43,48)(H,44,49)/t27-,28-,29-,33-,34-,35+,36-/m0/s1
QETFLADPCPUPIM-MVVOZHGUSA-N
CSID:78436610, http://www.chemspider.com/Chemical-Structure.78436610.html (accessed 10:57, Jun 27, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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