ID: 90910
SMILES:c12ccc(CCCCC)c(C)c1OC(CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.015
InChIKey:MSXGEJFNHZJFQF-UHFFFAOYSA-N
ID: 90911
SMILES:C1(O)C2(C)CC(O)(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.767
InChIKey:AXEYZWMWDIKLBX-UHFFFAOYSA-N
ID: 90912
SMILES:C(Oc1cc(C)c2c(c1C)CC(CC)C(C)(C)O2)=S
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.417
CB1 binding score: -17.102
InChIKey:JDLXWXJVFBKRAY-UHFFFAOYSA-N
ID: 90913
SMILES:O(C(c1c(C)cc(OC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2)o1)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -14.859
InChIKey:NIKKZJQPTIMHAF-UHFFFAOYSA-N
ID: 90914
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)C=CC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.121
InChIKey:PJBASZVNRDGSFZ-UHFFFAOYSA-N
ID: 90915
SMILES:CC(=CCc1c2c(ccc1C)-c1c(O)cc(CCCCC)cc1OC2c1ccccc1)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.719
CB1 binding score: -14.599
InChIKey:BDUQIJTUXRTHBG-UHFFFAOYSA-N
ID: 90916
SMILES:C1C2C(O)C3(Oc4c3c(O)cc(CCCCC)c4)OC2C=C(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.335
InChIKey:ZJZVKYPBDMCXOS-UHFFFAOYSA-N
ID: 90917
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(O)c(CC=C(C)C)cc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.447
InChIKey:GZNKCBVKBAVMSO-UHFFFAOYSA-N
ID: 90918
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 90919
SMILES:C12(C)CCC(C(C)C)(C(=O)CC(=O)C3(C)CC13)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -16.015
InChIKey:FMLKEDGKPZMAMO-UHFFFAOYSA-N
ID: 90920
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 90921
SMILES:C(C=C)Cc1cc2c(c(O)c1C=O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: Not available
InChIKey:PJQRZLPWWASHBL-UHFFFAOYSA-N
ID: 90922
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 90923
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)c(O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.138
InChIKey:BZHWTNCHQIQETM-UHFFFAOYSA-N
ID: 90924
SMILES:c1(O)c(C2C(C(C)(C)c3occc3C)CCC2=O)c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -13.732
InChIKey:LICRXWZQMUDCIV-UHFFFAOYSA-N
ID: 90925
SMILES:O1c2cc(CCC)c(C(=O)O)c(O)c2C2CC(CO)=CCC12CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.368
CB1 binding score: -15.374
InChIKey:RHCJAQBABAZYRN-UHFFFAOYSA-N
ID: 90926
SMILES:OCCc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)cc1C(O)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.524
InChIKey:MLRYGAGDEMVFJS-UHFFFAOYSA-N
ID: 90927
SMILES:C1(O)C(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 90928
SMILES:CC(=O)OCC1=CC(=O)C2C1(O)c1c(cc(CCCCC)cc1OC(=O)C)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.497
CB1 binding score: -15.307
InChIKey:DQGRRLCMGSJTRK-UHFFFAOYSA-N
ID: 90929
SMILES:c1ccccc1C(=O)OCC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.576
CB1 binding score: -18.675
InChIKey:HIDBWRUCPXEWNL-UHFFFAOYSA-N
ID: 90930
SMILES:C1CCC(C)(C)C2C(c3c(O)cc(CCCCC)cc3O)CC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.816
InChIKey:DRJNZPGSMICARY-UHFFFAOYSA-N