Try beta.chemspider
- 3 of 3 defined stereocentres
3-{(4S,7S,10S)-7-(5-Aminopentyl)-4-[(carboxymethyl)carbamoyl]-14-nitro-6,9,12-trioxo-3,4,5,6,7,8,9,10,11,12-decahydro-2H-1,5,8,11-benzoxatriazacyclotetradecin-10-yl}propanoic acid
[O-][N+](=O)c2cc1c(OCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCC(=O)O)CCCCCN)C(=O)NCC(=O)O)cc2
InChI=1S/C25H34N6O11/c26-10-3-1-2-4-16-24(38)30-18(23(37)27-13-21(34)35)9-11-42-19-7-5-14(31(40)41)12-15(19)22(36)28-17(25(39)29-16)6-8-20(32)33/h5,7,12,16-18H,1-4,6,8-11,13,26H2,(H,27,37)(H,28,36)(H,29,39)(H,30,38)(H,32,33)(H,34,35)/t16-,17-,18-/m0/s1
MCOQCOPMEHEDBI-BZSNNMDCSA-N
CSID:8364279, http://www.chemspider.com/Chemical-Structure.8364279.html (accessed 23:08, Jul 6, 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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