ID: 60040
SMILES:CC1(c2c(O)cc(-c3c(O)cc(CCCCC)cc3O)cc2O)CCC(C(C)(O)C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -16.472
InChIKey:XVDNJOTWYXMLKW-UHFFFAOYSA-N
ID: 60041
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)c1c(O)cc(C)cc12)C(=O)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: -17.583
InChIKey:KZFBSDACEVXOLV-UHFFFAOYSA-N
ID: 60042
SMILES:C(c1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 314.469
CB1 binding score: -18.27
InChIKey:PBVXSNIWCHRXCN-UHFFFAOYSA-N
ID: 60043
SMILES:C(Oc1c2c(cc(CCCCC)c1)OC(C)(C)c1ccc(C)cc1-2)CCN(C)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 409.614
CB1 binding score: -13.986
InChIKey:SGFPWSLETDUEDS-UHFFFAOYSA-N
ID: 60044
SMILES:C1C(C)=C(CCC(C)=CCc2c(O)ccc(CCCCC)c2)C(C(O)(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -14.376
InChIKey:HGMCMWNBNJDYSZ-UHFFFAOYSA-N
ID: 60045
SMILES:CC1(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: 60046
SMILES:CC(=CCc1c(O)cc(CCc2ccccc2)cc1O)CCC=C(CCCC(C)(C)O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -16.363
InChIKey:PTPLCKALQIIJMA-UHFFFAOYSA-N
ID: 60047
SMILES:c12c(c(O)c(CC=C(CCC=C(C)C)C)c(O)c1)OC(C)(C)C1CC(=O)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.735
InChIKey:HUESDFYUOWOTQR-UHFFFAOYSA-N
ID: 60048
SMILES:C(Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC21)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -16.206
InChIKey:LTBZRKCKKICVIC-UHFFFAOYSA-N
ID: 60049
SMILES:CC(OC1C(C)(C)CCCC2(C)Oc3c(c(OC)cc(CCCCC)c3)C21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -12.719
InChIKey:XAXPHIFFHZZBIV-UHFFFAOYSA-N
ID: 60050
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(C#CCC1(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -11.524
InChIKey:KKGHIPWUOFLWTE-UHFFFAOYSA-N
ID: 60051
SMILES:c1c2c(cc(O)c1)C1Cc3c(c(C(=O)O)cc(CCCCC)c3)C(C(C)(C)O)C1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.51
CB1 binding score: -15.92
InChIKey:WHHSOKZJVOXOQC-UHFFFAOYSA-N
ID: 60052
SMILES:C(Cc1cc(O)c(C2C(C(C)=C)CCC(C)C2)c(O)c1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.27
InChIKey:NHRQPZVTJJSDJT-UHFFFAOYSA-N
ID: 60053
SMILES:C(C)(=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: 60054
SMILES:C1(=O)C(=O)C(C)=C(CCC2(C)C=Cc3c(O)cc(CCCCC)cc3O2)C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -17.093
InChIKey:NLWSOZYNQGALIN-UHFFFAOYSA-N
ID: 60055
SMILES:c1(CCC(=O)C)cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.448
InChIKey:IXPMEWIKFLIBST-UHFFFAOYSA-N
ID: 60056
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCc4ccccc4)c3)C2=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.486
CB1 binding score: -14.986
InChIKey:BVSBPRCIOBZTOR-UHFFFAOYSA-N
ID: 60057
SMILES:C1(C=O)=CC2C(CC1)C(C)(C)Oc1cc(CCC)c(Cl)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.843
CB1 binding score: -15.933
InChIKey:QXFJXBLSLAMLBJ-UHFFFAOYSA-N
ID: 60058
SMILES:C(c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 314.469
CB1 binding score: -18.27
InChIKey:PBVXSNIWCHRXCN-UHFFFAOYSA-N
ID: 60059
SMILES:c1(O)c2c(c(O)cc1C)OC(C)(C)C1C2C(O)C(C)=CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.847
InChIKey:JFHQNFSVPDWTFI-UHFFFAOYSA-N
ID: 60060
SMILES:C1C(C)=CCC2(O)C(C)(C)CC2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.213
InChIKey:IJRZGQCUDONELA-UHFFFAOYSA-N