ID: 53635
SMILES:c1c(OC)c(CCCCCC)cc2c1C1=C(C(=O)OCC1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -14.543
InChIKey:ZNZIPMZHVVPFDW-UHFFFAOYSA-N
ID: 53636
SMILES:CC(OCc1cc(OC)c2c3c1OC(C)(C)C1CCC(C)(C21)C3)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.966
InChIKey:BBZSURVOHBIRFF-UHFFFAOYSA-N
ID: 53637
SMILES:C(CC(OC(=O)CC(C)C)C(=C)C)CC(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.174
InChIKey:SULWTFCULSXAKE-UHFFFAOYSA-N
ID: 53638
SMILES:C(C=C(C)C)CC=C1C2(C)CCCC1C(C)(C)Oc1cc(CCCCC)cc(OC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.669
CB1 binding score: -17.797
InChIKey:JGTDDFIUBHJLIF-UHFFFAOYSA-N
ID: 53639
SMILES:CC1(C)CCCC(C)C1Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.723
CB1 binding score: -14.412
InChIKey:PGNRTWPDWQTXBU-UHFFFAOYSA-N
ID: 53640
SMILES:C(C)(C1=CC2C(C)=CCC2=C(C)CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.691
CB1 binding score: -12.752
InChIKey:HVLMXIQUNAEFCI-UHFFFAOYSA-N
ID: 53641
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(C)(CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 53642
SMILES:C12CCC(C)CC1(O)C(C)(C)Oc1c2c(O)cc(CCC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -14.299
InChIKey:GSXHPGFVWFJBNM-UHFFFAOYSA-N
ID: 53643
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)C=CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.142
InChIKey:ZDKBHOITQRQBFF-UHFFFAOYSA-N
ID: 53644
SMILES:C(C)Cc1cc2c(c(O)c1)C=CC(CCC=C(C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 53645
SMILES:C(C)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 53646
SMILES:C1(=O)C2c3c(O)cc(C)cc3OC(C)(C)C2CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.439
InChIKey:NXWXGRHVAFTVMW-UHFFFAOYSA-N
ID: 53647
SMILES:C1c2c(O)cc(CCC)cc2C2C(CC=C(C)C2)C1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -14.939
InChIKey:XQISXJPTGQOXDR-UHFFFAOYSA-N
ID: 53648
SMILES:CC1=C2CCC(C)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.232
InChIKey:UQLRFVUKFXPACJ-UHFFFAOYSA-N
ID: 53649
SMILES:C12C(C(C)(C)Oc3cc(CCCCC(C)C)c(C)cc31)CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -12.152
InChIKey:UHFYPWWPYPSUQZ-UHFFFAOYSA-N
ID: 53650
SMILES:C1(C)(C)Cc2c(O)c3c(c(O)c2O1)C=CC(C)(CCC=C(C)C)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.005
InChIKey:MTAOBTIWRJINFJ-UHFFFAOYSA-N
ID: 53651
SMILES:CC1=CCC2C(C1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 53652
SMILES:CC(CCCc1cc2c(c(O)c1)OC1(C)C2C(C(C)C)CC1)CCC(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -16.013
InChIKey:WCFKFCOZOWWFHF-UHFFFAOYSA-N
ID: 53653
SMILES:CC(CCC=C(C)C)=CCCC(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 53654
SMILES:CC1C2C(c3c(cc(CCCCC)cc3O)OC2(C)C)C(O)C(C=O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.984
InChIKey:GYLCGFSNIRTRRG-UHFFFAOYSA-N
ID: 53655
SMILES:C1(C)(C)c2c3c(c(CCCCC)cc2O)OC2(C1CC(C(C)(C)O)C2O)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.242
InChIKey:AJIPDXIAJIKSBY-UHFFFAOYSA-N