ID: 114787
SMILES:C1(=O)C2=CC3Cc4c(cc(CCCCC)cc4O)OC3(C)OC2OC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.39
CB1 binding score: -12.285
InChIKey:ZXEWUWLDOUBYQL-UHFFFAOYSA-N
ID: 114788
SMILES:C1(=O)C2(C)c3c(cc(C)c(Br)c3OCc3c(O)cc(CCCCC)c(C(=O)OC)c3OC)CC(C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 603.55
CB1 binding score: -15.929
InChIKey:JUDHNMGJXWRJCH-UHFFFAOYSA-N
ID: 114789
SMILES:C1(C)=CC(c2c(O)cc(O)cc2CCC=C(C)CCC=C(C)C)C(O)C(O)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.055
InChIKey:KUCBRYFVIAMRNR-UHFFFAOYSA-N
ID: 114790
SMILES:C1=C(C)CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.34
InChIKey:OGJQLCBOIAPTMR-UHFFFAOYSA-N
ID: 114791
SMILES:C12C(CC(=O)c3ccccc31)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -14.255
InChIKey:OCTOMSSETIIDDX-UHFFFAOYSA-N
ID: 114792
SMILES:c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 114793
SMILES:C12c3c(O)cc(CCCCC)cc3OC1(C)CCC1C(C)(C)C(OC(CCC)=O)CCC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -12.869
InChIKey:DLLKOVTXIVPSGH-UHFFFAOYSA-N
ID: 114794
SMILES:CC(c1ccc2c(c1)OC(C)(C)C1C2C=C(CO)CC1)=CC=CC(C)=COC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -15.172
InChIKey:AXUWLJWSBGNDRG-UHFFFAOYSA-N
ID: 114795
SMILES:Oc1cc(CCCCC)cc2c1C1C(=C(C)CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.644
InChIKey:IEERHDNDIMSELQ-UHFFFAOYSA-N
ID: 114796
SMILES:c1(O)c2c(cc(C)c1)C1C(CC2)C(C)(C)OC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.306
CB1 binding score: -16.502
InChIKey:JNEDLKRNYVMGRP-UHFFFAOYSA-N
ID: 114797
SMILES:CC(C(=O)c1c(O)c(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.882
InChIKey:JCWYLMUMMZPKLG-UHFFFAOYSA-N
ID: 114798
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C=O)CC(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.681
InChIKey:UPBYCAAHRNKPBA-UHFFFAOYSA-N
ID: 114799
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 114800
SMILES:CC(C)c1c(=O)c(O)c(CCCCC)cc2c1CC(O)C(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -13.522
InChIKey:XHZBIFRGAFHEPB-UHFFFAOYSA-N
ID: 114801
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C1C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.401
InChIKey:VUKUZKSYXNLTPC-UHFFFAOYSA-N
ID: 114802
SMILES:c1(-c2cc(O)c(O)cc2)cc(O)c2c(c1)OC(C)(C)C(CC=C(CCC=C(C)C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -13.19
InChIKey:KPJDMCJFZHJUBG-UHFFFAOYSA-N
ID: 114803
SMILES:c1(OC)cc(C)cc(OC)c1C1C(C(C)=C)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.554
InChIKey:ICHJMVMWPKLUKT-UHFFFAOYSA-N
ID: 114804
SMILES:O(C)c1c(OC)c2c(c(O)c1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.334
InChIKey:HDYILKLDSQMBRZ-UHFFFAOYSA-N
ID: 114805
SMILES:C1(=C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 114806
SMILES:C=C(C)C1CC(O)C(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.385
InChIKey:YYLPAYRRVSQJRR-UHFFFAOYSA-N
ID: 114807
SMILES:C(CC)CCc1cc(O)c(C2CC(=C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.279
InChIKey:KLYPAQJXUITNGB-UHFFFAOYSA-N