ID: 110629
SMILES:C1Oc2c(cc(CCCCC)cc2)C1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.405
CB1 binding score: -14.237
InChIKey:KEXVIMFXBCCZCQ-UHFFFAOYSA-N
ID: 110630
SMILES:C1(=O)OC2CC(C)C3(CC(C(C)(C)O)(O)CC3)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -12.995
InChIKey:QBMIOVCJNVDHIO-UHFFFAOYSA-N
ID: 110631
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 110632
SMILES:C1(C)(CCC=C(C)C)C(O)Cc2c(O)c(C(OC)=O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -16.502
InChIKey:KHCWXSPIEKEWOV-UHFFFAOYSA-N
ID: 110633
SMILES:C(Cc1cc(O)c(CC2C(C)(C)OC(=O)CC=C2C)c(O)c1)C(CCCCC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -15.934
InChIKey:IGWXAWJBXBJQBZ-UHFFFAOYSA-N
ID: 110634
SMILES:C=C(C)C1OC(C)(c2c(O)cc(CCCCC)cc2O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.664
InChIKey:TVWPVKXLUXKEMJ-UHFFFAOYSA-N
ID: 110635
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.191
InChIKey:MGLWJJVAJQPDLK-UHFFFAOYSA-N
ID: 110636
SMILES:CC1(C)C2C1c1c(OC)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.813
InChIKey:RNXOOANUJUXMGF-UHFFFAOYSA-N
ID: 110637
SMILES:c1(=O)cc(C)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -16.086
InChIKey:JKNVYQARAQEBCA-UHFFFAOYSA-N
ID: 110638
SMILES:C1=Cc2c(c(O)cc(CCCCC)c2)C2C=C(C)C(C(=C)C)CC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.519
CB1 binding score: -15.986
InChIKey:YYALKKKRXLAANV-UHFFFAOYSA-N
ID: 110639
SMILES:C1(OC)=C(C)C2C(=C(C)C=C2)C(OC)C1C1(C)OC(C)(C)C(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.004
InChIKey:YKYDLAXHYDJJFC-UHFFFAOYSA-N
ID: 110640
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(CO)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 110641
SMILES:c12cc(CCCCC)cc(OC)c1C1C(=O)C(C)(C)OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.076
InChIKey:OONQUPYXCRTBIK-UHFFFAOYSA-N
ID: 110642
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C=C)(C)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.687
InChIKey:VKQHJUZBBDGVIA-UHFFFAOYSA-N
ID: 110643
SMILES:C(=O)(C)Oc1cc(C2C=C(C)CCC2C(C)=C)c(O)c(C=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.38
CB1 binding score: -15.358
InChIKey:RXGWRRNDLHSFDV-UHFFFAOYSA-N
ID: 110644
SMILES:CC(CCCc1cc2c(c(O)c1)C1=C(C3=C4C(C)(C)C(CC=C(C)C)C(C)(CC(C(=O)Oc5cc(C)cc(O)c5)=C4C3=O)O1)CC2=O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 678.866
CB1 binding score: Not available
InChIKey:AIJLPQROZNOWNH-UHFFFAOYSA-N
ID: 110645
SMILES:O1C(=O)CC(C(=C)C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -14.157
InChIKey:OIHLFPVNDJUVSA-UHFFFAOYSA-N
ID: 110646
SMILES:O1c2c(c(O)cc(CCCCC)c2)CC2C(C)(C)C1C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.225
InChIKey:LGGDKZRZMAPDSF-UHFFFAOYSA-N
ID: 110647
SMILES:C(C)OCCc1cc2c(c(O)c1)C1C(C(=C)C)CCC(C)(O2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -13.633
InChIKey:SFRROLPYFPMRTN-UHFFFAOYSA-N
ID: 110648
SMILES:c1(C)cc(OC2(C(C)C)CCC(C)=CC2)cc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -14.744
InChIKey:PLETYLQRQXUSSF-UHFFFAOYSA-N
ID: 110649
SMILES:O1C(C)(C)C2(CC=C(C)CC2)c2c(O)cc(C)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.101
InChIKey:APTNNMKCKFCUCT-UHFFFAOYSA-N