ID: 46012
SMILES:C1(CCC=C(C)C)C2(C)C(C)(CCC2)Oc2cc(CCCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -11.543
InChIKey:MUEHTXOWIXWBCN-UHFFFAOYSA-N
ID: 46013
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)CCC=C(C)C)CC(CCC=C(C)C)(C)C1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.723
CB1 binding score: -15.836
InChIKey:OEMLVBFXOXOFFX-UHFFFAOYSA-N
ID: 46014
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC=C(CO)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 46015
SMILES:C(C1C(C)(C)Oc2ccc(CCCCC)cc21)CC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.605
CB1 binding score: Not available
InChIKey:SDULWRMFVHCEDU-UHFFFAOYSA-N
ID: 46016
SMILES:C1C2C(C)(C)C(C)(CC2)c2c1cc(CCCCC)cc2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -16.967
InChIKey:SOVREZIIGOIPLC-UHFFFAOYSA-N
ID: 46017
SMILES:C(Cc1c(CCCCC)cc(O)c(C2C=C(C)CCC2C(=C)C)c1O)=C(CS(=O)(O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.652
CB1 binding score: -14.742
InChIKey:YOLLQPUBTWWDTL-UHFFFAOYSA-N
ID: 46018
SMILES:C(=C(C)C)C=CC1(C)C2c3c(cc(Cc4ccoc4)cc3O)OC(C)(C)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -17.191
InChIKey:QZOKWNBMUUHIBD-UHFFFAOYSA-N
ID: 46019
SMILES:C12C(O)(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.769
InChIKey:YKQWTCZDXOFGFC-UHFFFAOYSA-N
ID: 46020
SMILES:C1C(C(C)CCCO)C(C)(C)Oc2c1c(O)cc(CCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.446
CB1 binding score: -15.85
InChIKey:SAQVQDKYYORAAU-UHFFFAOYSA-N
ID: 46021
SMILES:C(C)c1cc2c(cc1O)C=CC(C)(CCC=C(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.214
InChIKey:NXVODPWNAQFAQK-UHFFFAOYSA-N
ID: 46022
SMILES:C1=C(C)CCC=C(C)CCC2C(C)(C)Oc3c(cc(C)cc3)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.481
CB1 binding score: -14.837
InChIKey:IOPIYMOLJXVCIA-UHFFFAOYSA-N
ID: 46023
SMILES:C(CCC)Cc1cc2c(c(O)c1C(OC)=O)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.122
InChIKey:GHQWHEOOZNZPEX-UHFFFAOYSA-N
ID: 46024
SMILES:C1(O)C(O)C(C)=CCCC(C)=CC(O)C2c3c(O)cc(CCCCC)cc3OC2(C)C=CC=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -16.502
InChIKey:ZVYMQRGCSFPOHZ-UHFFFAOYSA-N
ID: 46025
SMILES:C1(C)C2C(C)(CCC1)Oc1c(c(O)cc(CCCCC)c1)C2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.691
InChIKey:QJTKUGWBZQXAAZ-UHFFFAOYSA-N
ID: 46026
SMILES:O=SCC1=CC2C(CCC1(O)C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.588
CB1 binding score: -16.502
InChIKey:QABGTLQOXMRPKZ-UHFFFAOYSA-N
ID: 46027
SMILES:O=C(Oc1c2c(c(C(OC)C)c(OC3C(O)C(O)C(O)C(CO)O3)c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.591
CB1 binding score: -15.929
InChIKey:JZXJWLLNKLDBEE-UHFFFAOYSA-N
ID: 46028
SMILES:c1c(CCCC)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.695
InChIKey:WSKMUJIWPUNQEU-UHFFFAOYSA-N
ID: 46029
SMILES:CC1(CCC=C(C)C)CCCC2(C)Oc3cc(CCCCC)cc(OC)c3C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.739
InChIKey:FKMSUBSVJPSMSV-UHFFFAOYSA-N
ID: 46030
SMILES:C1=C(C)CCC(C(C)=C)C1c1c2c(c(O)c(O)cc2C)ccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.421
CB1 binding score: -17.323
InChIKey:JTMOFLBDAZVCOL-UHFFFAOYSA-N
ID: 46031
SMILES:C(=C(C)C)CCC(C)=CCc1cc(O)cc(CCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -17.917
InChIKey:BYYZHJIATPYDTN-UHFFFAOYSA-N
ID: 46032
SMILES:CC(C(c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.864
InChIKey:IIOWIIPFTUYHTO-UHFFFAOYSA-N