ID: 111028
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 111029
SMILES:C(C)(=CCc1c(O)cc(CCCCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 111030
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 111031
SMILES:c1(O)cc(C2C(C(=C)C)CCC(C)=C2)c(O)cc1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19
InChIKey:VCUWNGMQOOFWFS-UHFFFAOYSA-N
ID: 111032
SMILES:c1(CCCC(O)(C)C)cc(C)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -12.963
InChIKey:ADDJYCCOFLKANV-UHFFFAOYSA-N
ID: 111033
SMILES:C1(C)=CC(c2c(O)c(O)cc(C)c2)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.334
InChIKey:IYBXCHQIWCXGMJ-UHFFFAOYSA-N
ID: 111034
SMILES:C(C1(C)CCC(C)=CC1c1c(O)c(C(=O)OC)c(CCCCC)cc1O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -17.26
InChIKey:LLPKEZHVXQSBGR-UHFFFAOYSA-N
ID: 111035
SMILES:C1(C)(C)Oc2c(c(O)cc(C)c2)C(C(=CCC=C(C)C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.179
InChIKey:VPSMYLIHIXICSO-UHFFFAOYSA-N
ID: 111036
SMILES:C1C2c3c(O)cc(CCCCCCCCC)cc3OC2(C)CCC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -15.929
InChIKey:PHOMEYBDAQPCIR-UHFFFAOYSA-N
ID: 111037
SMILES:C12(C)Oc3cc(CCCCC)cc(C=O)c3C1C(OC(C)=O)C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.323
InChIKey:VTSVFDYWIGVMJK-UHFFFAOYSA-N
ID: 111038
SMILES:c1(CC=O)cc2c(c(O)c1)C1C(C(C)=CCC1C(C)=C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.355
CB1 binding score: -13.156
InChIKey:BCOYAYUVHLYUGP-UHFFFAOYSA-N
ID: 111039
SMILES:C(C12CC(CCC1C)C2(C)C)c1cc(CCCCC)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -13.253
InChIKey:CTYWGZPLGDUAHI-UHFFFAOYSA-N
ID: 111040
SMILES:c1(O)c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 111041
SMILES:c1c(O)c(C2C(C(=C)C)CCC(C)=C2)c(CCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.416
CB1 binding score: -17.021
InChIKey:CSLULSONFWEIJJ-UHFFFAOYSA-N
ID: 111042
SMILES:C1CC(=O)C(C)(C)C23Oc4c(c(O)cc(CCCCC)c4)C(=O)C12C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.929
InChIKey:UUKIZEFMYYKBCG-UHFFFAOYSA-N
ID: 111043
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 111044
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.609
InChIKey:HAKUWGCTBUVNJQ-UHFFFAOYSA-N
ID: 111045
SMILES:CC(C)C1CCC2(C)C(O)C1c1c(OC(C)=O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.367
InChIKey:IGZRURFZCJFPOM-UHFFFAOYSA-N
ID: 111046
SMILES:C(C=C(C)C)(Oc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(=O)OC)=CC21)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -13.076
InChIKey:OFPWOLLZTCIBSF-UHFFFAOYSA-N
ID: 111047
SMILES:CC(C)(c1cc(O)c2c(c1)OC(C)(C)C=C2)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -10.934
InChIKey:UPYBAMMOYVEFJQ-UHFFFAOYSA-N
ID: 111048
SMILES:Cc1c(C2C=C(C)CCC2C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -17.825
InChIKey:SBNHDVINUVKXIY-UHFFFAOYSA-N