ID: 31018
SMILES:CC1(C)Oc2c(ccc(CCCC)c2)C2CCC(C)=CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -15.302
InChIKey:SSQVJGKMBGLETO-UHFFFAOYSA-N
ID: 31019
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C(C=C(C)CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.951
InChIKey:CSAQQDLBKSCGOR-UHFFFAOYSA-N
ID: 31020
SMILES:c1(O)c(C(C(C)C)=O)c2c(c(O)c1C(=O)O)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -16.718
InChIKey:JHMLQHJTQUUUNV-UHFFFAOYSA-N
ID: 31021
SMILES:C1(C)=CC2C(C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.053
InChIKey:QFWAXBJXEKSOFG-UHFFFAOYSA-N
ID: 31022
SMILES:O1C(C)(C)C2Oc3c(ccc(CCCC(=O)C)c3)C2=CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.354
CB1 binding score: -14.461
InChIKey:GEKQUZUOEBXONN-UHFFFAOYSA-N
ID: 31023
SMILES:c12c(c(OC(=O)C)c(CCC(OC(C)=O)CC)cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -15.929
InChIKey:JTFYROKOAAIDNT-UHFFFAOYSA-N
ID: 31024
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(CCC(O)(C)C2)C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.735
InChIKey:DOJWKZIUUGQNFS-UHFFFAOYSA-N
ID: 31025
SMILES:C12c3c(cc(CCCCC)cc3OC(C)=O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 31026
SMILES:COc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 31027
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1=CC(C)(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.015
InChIKey:PCNNREMMHAKICW-UHFFFAOYSA-N
ID: 31028
SMILES:CSC12CCC3C(C)(C)Oc4cc(CCCCC)cc(c43)OC1(C)CCC2C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.682
CB1 binding score: -14.129
InChIKey:LRRCGTGEQVVQHC-UHFFFAOYSA-N
ID: 31029
SMILES:c1(OCC)c(CC=C(CCC=C(C)C)C)c(O)c2c(c1C(O)=O)cc(C1C(C(C)=C)CCC(C)=C1)c(O)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.694
CB1 binding score: -14.861
InChIKey:AYBGWLZPONWYHF-UHFFFAOYSA-N
ID: 31030
SMILES:C1C=C(C)CC2C1C(C)(C)Oc1c2ccc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -18.541
InChIKey:DXDRGIVLXHOGHC-UHFFFAOYSA-N
ID: 31031
SMILES:CC(=O)CC1c2c(O)cc(CCCCC)cc2OC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.021
InChIKey:LJZXQJUFWNYJQV-UHFFFAOYSA-N
ID: 31032
SMILES:CC1(C)C=Cc2c(c(C(O)=O)c(CCCCC)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -17.796
InChIKey:JRDXSDYHHLODOB-UHFFFAOYSA-N
ID: 31033
SMILES:C1C(C)=CC(c2ccc(O)cc2O)C(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.171
InChIKey:HFDMGJLGHZDMNB-UHFFFAOYSA-N
ID: 31034
SMILES:C1C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 31035
SMILES:C(C1=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c32)C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.329
InChIKey:FXEPMOTZQHLQSU-UHFFFAOYSA-N
ID: 31036
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)c(Br)c(C)c(Cl)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 371.702
CB1 binding score: -16.185
InChIKey:QRJSMEYKOCGCJH-UHFFFAOYSA-N
ID: 31037
SMILES:C1CC2(C)Oc3c(ccc(CCCCC)c3)C3C2C(CC2(C)C3C1C(C)C)C(=O)CC2C(=O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -14.463
InChIKey:RXSYMYFCTKMZFI-UHFFFAOYSA-N
ID: 31038
SMILES:c1(O)cc(CC=C(C)C)c(OC(C2CCC(OC(CC(C)C)=O)(C)C=C2)=O)c(O)c1C1C(=O)C(C)(C)OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 556.696
CB1 binding score: -15.267
InChIKey:VUVIXVNVHRWPSN-UHFFFAOYSA-N