ID: 53215
SMILES:C1C2Oc3c(c(O)cc(CCC)c3)C(O2)C=C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.306
CB1 binding score: -15.402
InChIKey:KFQHHMHNOUBKAY-UHFFFAOYSA-N
ID: 53216
SMILES:C1(C)(C)C(c2c(O)cc(CCC)cc2O)CC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -14.377
InChIKey:UFDBFYJKXKXTRQ-UHFFFAOYSA-N
ID: 53217
SMILES:C12(OO)C=C(C)CCC1C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -15.761
InChIKey:HYZJKKYHMHNMCE-UHFFFAOYSA-N
ID: 53218
SMILES:c1(O)cc(CCCCC)cc2c1C1C=C(C(=O)O)CCC1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.531
InChIKey:MNPOCGUOPCCMCZ-UHFFFAOYSA-N
ID: 53219
SMILES:c1(OC)c2c(cc(C(O)C(C)(C)O)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.492
InChIKey:QNKQWGRDJWDQIV-UHFFFAOYSA-N
ID: 53220
SMILES:C1(=O)C(C)CC2C(C1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.046
InChIKey:UECUNLJHUBNWSC-UHFFFAOYSA-N
ID: 53221
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(COC(=O)C)CCC2C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -12.617
InChIKey:HTTRHYNRDKZYSI-UHFFFAOYSA-N
ID: 53222
SMILES:C(C)(=CCCC(C)=CCc1c(O)c(C(=O)O)cc(CCCCC)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 344.495
CB1 binding score: -19.654
InChIKey:TURBAOCYHPEVOM-UHFFFAOYSA-N
ID: 53223
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCCO)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.781
InChIKey:CTZSPTCATADZMP-UHFFFAOYSA-N
ID: 53224
SMILES:c1(C=O)c(CCCCC)cc(O)c2c1OC1C3C(CC=C(C)C2)(O3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.382
InChIKey:FPJTYOZZNCHRRE-UHFFFAOYSA-N
ID: 53225
SMILES:BrCCc1c2c(c(O)c(C)c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 381.31
CB1 binding score: -14.703
InChIKey:PHPXXJFARIYNCC-UHFFFAOYSA-N
ID: 53226
SMILES:C1C(C)(CCCC)Oc2c(c(O)c(C(=O)OC)c(CCC)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.635
InChIKey:AOAZCLWZSIUGCC-UHFFFAOYSA-N
ID: 53227
SMILES:C(O)C(=CCCC(=CCc1c(O)cc(CCCCCCO)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: Not available
InChIKey:JMHYUHBJAZKPQH-UHFFFAOYSA-N
ID: 53228
SMILES:CC(C)C1C2C(=O)CC(C)CC2c2c(cc(CCCCCO)cc2O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.701
InChIKey:PXHMPEUTALJDOT-UHFFFAOYSA-N
ID: 53229
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 53230
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCN(C)C)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.527
CB1 binding score: -16.818
InChIKey:GNKWRUSNYRVVSB-UHFFFAOYSA-N
ID: 53231
SMILES:O1C(C)(C)C2CCC(C)=CC2c2c1c(C(O)=O)c(O)c(C)c2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -16.521
InChIKey:GSDKCKRYQSFNKJ-UHFFFAOYSA-N
ID: 53232
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)-c2c1ccc(C)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 53233
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 53234
SMILES:CC1(C)Oc2cc(CCC)cc(O)c2C2C1CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -19.829
InChIKey:JXXVDKGGZIPBOC-UHFFFAOYSA-N
ID: 53235
SMILES:C(CCCc1cc2c(cc1C1(C)C(C)CCC(C(C)C)=C1)CC(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.632
CB1 binding score: -14.924
InChIKey:OSCUUPLGYHOEQG-UHFFFAOYSA-N