ID: 85009
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C(=O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 85010
SMILES:O=C(c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.929
InChIKey:LWDUFLJORXJLPL-UHFFFAOYSA-N
ID: 85011
SMILES:CC12OC1C1c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(CCC=C(C)C)C(CC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.67
InChIKey:XUQJNCNZFSUVBE-UHFFFAOYSA-N
ID: 85012
SMILES:C(CCC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -19.381
InChIKey:ZGUWKQMGZPIDQH-UHFFFAOYSA-N
ID: 85013
SMILES:C(=O)(Oc1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1)Cc1ccccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.604
CB1 binding score: -14.579
InChIKey:VZFBGWGLGJMOEL-UHFFFAOYSA-N
ID: 85014
SMILES:C(CCCC)c1cc(C2C=C(C)CCC2C(C)C)c(O)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.819
InChIKey:RZMKUSQJYZLTNA-UHFFFAOYSA-N
ID: 85015
SMILES:Oc1c(C(OC(CCC)=O)C(C)C)cc(O)c2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.768
InChIKey:HVKULKJPOYVLAW-UHFFFAOYSA-N
ID: 85016
SMILES:OC1C=C2C(C)(Oc3c2c(O)cc(CCCCC)c3)C2CC(C)(O)CCC2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.605
InChIKey:BJQIIUSMHCFBEC-UHFFFAOYSA-N
ID: 85017
SMILES:C1=C(C=O)CCC(C)(C)C=CCC2(C)Oc3c(c(O)cc(CCCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -12.484
InChIKey:JIVTZELWEROEBL-UHFFFAOYSA-N
ID: 85018
SMILES:C(C)(C=CC=C(C)CCC=C(C)C)C1=CC2c3c(cc(CCCCC)cc3O1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.664
CB1 binding score: -17.1
InChIKey:HBVKWUVDZTVJRY-UHFFFAOYSA-N
ID: 85019
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C(=O)C1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.431
InChIKey:JAIOKAXJKVHHLV-UHFFFAOYSA-N
ID: 85020
SMILES:CC(C)=CCC1CC(C=C)(C)Oc2cc(CCCC)c(C(=O)OC)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.858
InChIKey:JWULMRRCOPRYPA-UHFFFAOYSA-N
ID: 85021
SMILES:c1c(CCCC(CCC)CO)cc(O)c(C2C(C(=C)C)CCC(C)=C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -16.79
InChIKey:RUEVTFXWRALAHM-UHFFFAOYSA-N
ID: 85022
SMILES:C1(C)C(C)=CCC(C)C12Cc1c(cccc1)OC2(CC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -13.721
InChIKey:UBQBQPANKMXXAI-UHFFFAOYSA-N
ID: 85023
SMILES:c12c3c(O)c(C)cc1OC(C)(C)C1C3C(CC2)C(C)C(OC)C=CC(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.302
InChIKey:YBBAFLPEKLIFNZ-UHFFFAOYSA-N
ID: 85024
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -20.193
InChIKey:JBVDVYKKJWEHPH-UHFFFAOYSA-N
ID: 85025
SMILES:c1(-c2oc(=O)c(C3C=C(C)CCC3C(C)C)c(O)c2)c2c(c(C(=O)O)cc1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.65
CB1 binding score: -15.717
InChIKey:FATWQLAEONILBP-UHFFFAOYSA-N
ID: 85026
SMILES:C1(C)CC(c2c(O)cc(CCCCCO)cc2O)CC(C=C)(C)C1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.061
InChIKey:GLXGBSFADQWPKJ-UHFFFAOYSA-N
ID: 85027
SMILES:C(C)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.74
InChIKey:LOTDDTUGTHRRKX-UHFFFAOYSA-N
ID: 85028
SMILES:O=Cc1c(O)c(C(CC(C)C)=O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.09
InChIKey:NPLCLQUUYJOSDO-UHFFFAOYSA-N
ID: 85029
SMILES:Oc1c2c(c(O)c(CC(C(=CCC=C(C)C)C)COC(=O)C)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -16.403
InChIKey:XRFDMKHMJVEPMF-UHFFFAOYSA-N