ID: 12895
SMILES:c1(CC=C)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.957
InChIKey:MTBKFELEBUQONK-UHFFFAOYSA-N
ID: 12896
SMILES:C1(C)=CCC2(c3c(O)cc(CCCCC)cc3OC2(C)C)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.078
InChIKey:HLACRFQMSHYIEX-UHFFFAOYSA-N
ID: 12897
SMILES:C(=O)(C)Oc1cc(CCCCC)cc(O)c1C1C=C(CCC=C(C)C)C(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.744
InChIKey:OTJQLJHJAJXHNZ-UHFFFAOYSA-N
ID: 12898
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3C3C4C(C)(O)CCC(C(=C)C)C4CC32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.679
CB1 binding score: -12.143
InChIKey:GNVRUFWVPPWYBT-UHFFFAOYSA-N
ID: 12899
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)c(C(=O)CC(C)C)c(O)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.439
InChIKey:MMBSMBBFKYDYEQ-UHFFFAOYSA-N
ID: 12900
SMILES:c1cc(C2C=C(C)CCC2C(C)=C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 12901
SMILES:C(C1(C)Oc2c(c3c(c(OC)c2)CC2C(C(=C)C)CCC32C)c(OC)c1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.348
InChIKey:FRBXRNSCNVSTAT-UHFFFAOYSA-N
ID: 12902
SMILES:c12cc(CCC(=O)O)ccc1OC(C)(C)C1C2CC(C(=O)O)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.38
CB1 binding score: -15.648
InChIKey:HOTSOTHZNXAZAL-UHFFFAOYSA-N
ID: 12903
SMILES:c12c(c(OC)cc(CCCCC)c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.762
InChIKey:MYIRUABJMYHJQU-UHFFFAOYSA-N
ID: 12904
SMILES:C1CC2(C)OC3c4c(cc(CCCCC)cc4OC(C)=O)OC(C)(C)C3CC2C(O)(C)C1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.648
CB1 binding score: -14.958
InChIKey:PIOSFNNTJLVEEJ-UHFFFAOYSA-N
ID: 12905
SMILES:CC1=CC2c3c(O)cc(C)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 12906
SMILES:O(c1cc(C)cc2c1C1C(C(C)(C)O2)CCC(C)(O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -16.491
InChIKey:RDMDOVKZWCEWLG-UHFFFAOYSA-N
ID: 12907
SMILES:c12c(c(O)cc(CCCCCCCC)c1)C1(C)C(C)(C(C)=CCC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -19.305
InChIKey:HCICMQHGXJEOFA-UHFFFAOYSA-N
ID: 12908
SMILES:C12C(C(C)(C)Oc3cc(O)c(C)cc31)CC(CC=C(CO)CCC=C(C)C)C=C2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -13.513
InChIKey:SVHGOPUPQFTPSP-UHFFFAOYSA-N
ID: 12909
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1(O)C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.751
InChIKey:UOSWLQIIJRKKSU-UHFFFAOYSA-N
ID: 12910
SMILES:C1=CC(C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 12911
SMILES:O(Cc1cc(CC=C(CCC=C(C)C)C)c(O)c(O)c1)C(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -16.374
InChIKey:URVJFSPXTHYVPW-UHFFFAOYSA-N
ID: 12912
SMILES:C(C)(=C)C1CCC(=C)CC1c1c(O)cc(C(CC(C)=CCCCCC)O)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.298
InChIKey:RSGORRBKZJSBBR-UHFFFAOYSA-N
ID: 12913
SMILES:c1(O)c(S(=O)(=O)O)c(CCCCC)cc2c1C1CC(C)(C)CC1c1c-2cc(CCC)c2c1CC(O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 556.765
CB1 binding score: -15.356
InChIKey:FCHWSAOMGSHOOC-UHFFFAOYSA-N
ID: 12914
SMILES:CC(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 12915
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1=C2C(=O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.604
InChIKey:AUPXTHSHVYGTBU-UHFFFAOYSA-N