ID: 97819
SMILES:c1(O)ccc2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.912
InChIKey:JKUWZILTAIFPQY-UHFFFAOYSA-N
ID: 97820
SMILES:C(C(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)=O)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.798
InChIKey:NVBSABGADMKSOC-UHFFFAOYSA-N
ID: 97821
SMILES:CCOC(=O)c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c(CC=C(C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -16.94
InChIKey:PBZMMOWGEAZHPS-UHFFFAOYSA-N
ID: 97822
SMILES:c1(CCCC)cc(O)c(C2OC=C(C=O)C3C2C(C)CO3)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -16.717
InChIKey:ACVKSCWSUQGOLX-UHFFFAOYSA-N
ID: 97823
SMILES:C(=CCCC(=CCCC(=CCc1cc(O)c(CC(=O)O)c(O)c1)C)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 372.505
CB1 binding score: -16.864
InChIKey:NODJEBKLXTVHBF-UHFFFAOYSA-N
ID: 97824
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CC(=O)C(C)=CC)C(C)(O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.185
InChIKey:XLRVPMISUYNMBG-UHFFFAOYSA-N
ID: 97825
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 97826
SMILES:c1c(OCC=C(CC(OCC)C=C(C)C)C)cc2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.434
InChIKey:RZDCMUORMGNBNS-UHFFFAOYSA-N
ID: 97827
SMILES:O1c2c(cc(CCCCC)cc2O)C2C(C)(O2)CCC2C(C)(C)OC(C1=O)CC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.587
InChIKey:UTSMSFFXQAOGIJ-UHFFFAOYSA-N
ID: 97828
SMILES:OC(c1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -18.309
InChIKey:KYBSQVMEBKBMOK-UHFFFAOYSA-N
ID: 97829
SMILES:CC1(C)Oc2cc(CCCCC)c(C(O)=O)c(O)c2C2=C(C(C)C)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.717
InChIKey:BCOCRUMMBLRDPP-UHFFFAOYSA-N
ID: 97830
SMILES:C(CCCC)Cc1c2c(c3c(c1O)CC1C(C)(O)CCC1C(C)(C)O3)OC(C=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -16.078
InChIKey:JCXUZHNXFNXWTN-UHFFFAOYSA-N
ID: 97831
SMILES:O(C(C)=O)C1C(OC(C)=O)C(Oc2cc(CC=C(C)CCC=C(C)C)c(O)cc2C)OC(COC(C)=O)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.629
CB1 binding score: -16.068
InChIKey:XLNLXLDTFMIEMU-UHFFFAOYSA-N
ID: 97832
SMILES:c1(O)c(CCCC)cc2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.203
InChIKey:SPASCVIZYLVDSD-UHFFFAOYSA-N
ID: 97833
SMILES:C(CCCC)c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 97834
SMILES:C(O)C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 97835
SMILES:C12C=C(CO)C(C)CC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.705
InChIKey:BWVPXQDJMUYPMZ-UHFFFAOYSA-N
ID: 97836
SMILES:O(c1cc(CCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -16.365
InChIKey:DQRVACVRJKJHAO-UHFFFAOYSA-N
ID: 97837
SMILES:C12C(C)(O)CCC=C(C)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -17.093
InChIKey:CBTPIOMAJKYHLC-UHFFFAOYSA-N
ID: 97838
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)c(C(=O)O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 97839
SMILES:C1CCC(C)(C)Oc2ccc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.394
CB1 binding score: -15.598
InChIKey:GQEIZJDJTMRAGA-UHFFFAOYSA-N