ID: 22198
SMILES:C(Cc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)CC(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -17.274
InChIKey:NKVXDLUYNQVIMY-UHFFFAOYSA-N
ID: 22199
SMILES:c1(C)cc(O)c2c(c1)OC(CO)(C)C2CCC(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 266.337
CB1 binding score: -15.607
InChIKey:OHWBRTRNJMULCR-UHFFFAOYSA-N
ID: 22200
SMILES:c1c(O)c2c(cc1CCCCC)OC1(C)CC=C(C(C)CCC(O)C(OC)(C)C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -13.102
InChIKey:OBGDDXTYTKVWBD-UHFFFAOYSA-N
ID: 22201
SMILES:OC1C(O)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1OC1OC(CO)C(O)C(O)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.531
CB1 binding score: -15.157
InChIKey:YFQKYTRGFPZVMT-UHFFFAOYSA-N
ID: 22202
SMILES:C(CCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.689
InChIKey:WNPKXZGXEILAIQ-UHFFFAOYSA-N
ID: 22203
SMILES:C(CCc1cc2c(c(OC)c1)C1C(C(C)(C)O2)CCC(C)=C1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 22204
SMILES:CC12CCC(OC(=O)C)C(C)(COC(c3ccccc3)=O)C1Cc1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.628
CB1 binding score: -14.074
InChIKey:MJWYUDGASTWUOG-UHFFFAOYSA-N
ID: 22205
SMILES:O=C(OCc1cc(O)c2c(c1C(=O)C)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -14.544
InChIKey:VCRZRSMKTBYMTD-UHFFFAOYSA-N
ID: 22206
SMILES:C1CCC2(CCCl)Oc3c(c(O)cc(CCCCCCCCC)c3)C1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.956
CB1 binding score: -12.618
InChIKey:GWNJURUUFBBYQE-UHFFFAOYSA-N
ID: 22207
SMILES:C(c1c2c(ccc1OC(C)=O)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -14.748
InChIKey:FZGPREBBQGEQJM-UHFFFAOYSA-N
ID: 22208
SMILES:C(CCCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C(O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.422
InChIKey:ONEUKPJXXAERDP-UHFFFAOYSA-N
ID: 22209
SMILES:c1(CCC)cc2c(cc1O)OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -13.5
InChIKey:BQBLIZLJXGMPKN-UHFFFAOYSA-N
ID: 22210
SMILES:C(=C)(C)C(Cc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: Not available
InChIKey:ZNNKGZLCLOGSAE-UHFFFAOYSA-N
ID: 22211
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(COC(=O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.007
InChIKey:KDNNPXMACKUHBU-UHFFFAOYSA-N
ID: 22212
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(C)(O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.402
InChIKey:LXADBAQHQWMXJF-UHFFFAOYSA-N
ID: 22213
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(CCC(C)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.69
InChIKey:VZITYWYBMUXCLP-UHFFFAOYSA-N
ID: 22214
SMILES:O(C)c1c(O)c(C)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.249
InChIKey:BCELDCLXKODAIY-UHFFFAOYSA-N
ID: 22215
SMILES:C(=C)c1c(-c2c(O)cc(CCCCC)cc2O)cc(CCCC)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -15.806
InChIKey:INQHLNNRBWSARJ-UHFFFAOYSA-N
ID: 22216
SMILES:C(CCCc1cc(OC)c(C2C(C(C)=C)CC(Cl)C(C)=C2)cc1)C=CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 481.164
CB1 binding score: -15.67
InChIKey:CUYGSMUVYLWYSG-UHFFFAOYSA-N
ID: 22217
SMILES:CC(CCCC(C)C)CCCC(C1CC(c2c(O)cc(CCCCC)cc2O)C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.771
CB1 binding score: -13.552
InChIKey:NMPYIUKAABVFBG-UHFFFAOYSA-N
ID: 22218
SMILES:C1(C)(CCC(=CC(O)C2OC2(C)C)C)C=Cc2c(cc(C)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.929
InChIKey:LNODEAUIIBGTEE-UHFFFAOYSA-N